Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPH2 | Q8IWU9 | 19/20 | 0.62 |
| ▸ | TPH1 | P17752 | 18/20 | 0.62 |
| ▸ | USP1 | O94782 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL22365623 | 0.86 | TPH2 (0.60) | TPH2TPH1 | |
| SCHEMBL19810120 | 0.77 | TPH2 (1.00) | TPH2TPH1 | |
| SCHEMBL19813990 | 0.75 | TPH2 (0.57) | TPH2TPH1 | |
| SCHEMBL22365667 | 0.72 | TPH1 (0.58) | TPH2TPH1 | |
| SCHEMBL19827313 | 0.68 | TPH2 (0.58) | TPH2TPH1 | |
| SCHEMBL19827111 | 0.64 | TPH2 (1.00) | TPH2TPH1 | |
| SCHEMBL19810129 | 0.64 | TPH2 (1.00) | TPH2TPH1 | |
| SCHEMBL20707674 | 0.63 | TPH1 (0.59) | TPH2TPH1 | |
| SCHEMBL19810125 | 0.63 | TPH2 (1.00) | TPH2TPH1 | |
| SCHEMBL19827090 | 0.63 | TPH2 (1.00) | TPH2TPH1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3275885-A1 | XANTHINE DERIVATIVES, THEIR USE AS A MEDICAMENT, AND PHARMACEUTICAL PREPARATIONS COMPRISING THE SAME | Max-Delbrück-Centrum für Molekulare Medizin (DE) | 2018-01-31 | — | — | EP | disclosed |